4-[[(2S)-2-(2,4-dioxo-1H-quinazolin-3-yl)-4-methylsulfanylbutanoyl]amino]butanoic acid
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![4-[[(2S)-2-(2,4-dioxo-1H-quinazolin-3-yl)-4-methylsulfanylbutanoyl]amino]butanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/02e67633c12d41a3b858cf2f12dc1cd4.png "4-[[(2S)-2-(2,4-dioxo-1H-quinazolin-3-yl)-4-methylsulfanylbutanoyl]amino]butanoic acid")
4-[[(2S)-2-(2,4-dioxo-1H-quinazolin-3-yl)-4-methylsulfanylbutanoyl]amino]butanoic acid
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CAS No:
1173673-24-9
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Formula:
C17H21N3O5S
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Chemical Name:
4-[[(2S)-2-(2,4-dioxo-1H-quinazolin-3-yl)-4-methylsulfanylbutanoyl]amino]butanoic acid
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Synonyms:
ZINC2128802;STL534415;AKOS032428853;AKOS037496682;MCULE-6257289021;(S)-4-(2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-4-(methylthio)butanamido)butanoic acid;1173673-24-9;4-{[(2S)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)-4-(methylsulfanyl)butanoyl]amino}butanoic acid
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CAS No:
4-[[(2S)-2-(2,4-dioxo-1H-quinazolin-3-yl)-4-methylsulfanylbutanoyl]amino]butanoic acid Basic Attributes
379.4 g/mol
379.12019195 g/mol
Computed Properties
Molecular Weight:379.4
XLogP3:0.9
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:9
Exact Mass:379.12019195
Monoisotopic Mass:379.12019195
Topological Polar Surface Area:141
Heavy Atom Count:26
Complexity:557
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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